6-aminonona-7,8-dien-3-ol

C9H17NO — CID 88716045

IUPAC6-aminonona-7,8-dien-3-ol
SMILESC=C=CC(N)CCC(O)CC
InChIInChI=1S/C9H17NO/c1-3-5-8(10)6-7-9(11)4-2/h5,8-9,11H,1,4,6-7,10H2,2H3
InChIKeyQIGXDYRFUOAEDC-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.21
Rot. Bonds5

About 6-aminonona-7,8-dien-3-ol

6-aminonona-7,8-dien-3-ol (PubChem CID 88716045) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 6-aminonona-7,8-dien-3-ol.

Molecular Properties

Compound Name6-aminonona-7,8-dien-3-ol
PubChem CID88716045
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name6-aminonona-7,8-dien-3-ol
SMILESC=C=CC(N)CCC(O)CC
InChIInChI=1S/C9H17NO/c1-3-5-8(10)6-7-9(11)4-2/h5,8-9,11H,1,4,6-7,10H2,2H3
InChIKeyQIGXDYRFUOAEDC-UHFFFAOYSA-N
XLogP1.21
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-aminonona-7,8-dien-3-ol?
The IUPAC name of 6-aminonona-7,8-dien-3-ol (CID 88716045) is 6-aminonona-7,8-dien-3-ol.
What is the SMILES notation for 6-aminonona-7,8-dien-3-ol?
The canonical SMILES for 6-aminonona-7,8-dien-3-ol is C=C=CC(N)CCC(O)CC.
What is the InChIKey of 6-aminonona-7,8-dien-3-ol?
The InChIKey is QIGXDYRFUOAEDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-3-5-8(10)6-7-9(11)4-2/h5,8-9,11H,1,4,6-7,10H2,2H3.
What are the key properties of 6-aminonona-7,8-dien-3-ol?
6-aminonona-7,8-dien-3-ol has a molecular weight of 155.24 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-aminonona-7,8-dien-3-ol is sourced from PubChem (CID 88716045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).